2-[2-[(4-methoxyphenyl)sulfanylmethyl]-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[(4-methoxyphenyl)sulfanylmethyl]-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile Openeye Name: 2-[2-[(4-methoxyphenyl)sulfanylmethyl]-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]acetonitrile CAS Name: 2-[2-[[(4-methoxyphenyl)thio]methyl]-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl]acetonitrile IUPAC Name: 2-[2-[(4-methoxyphenyl)sulfanylmethyl]-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl]acetonitrile Traditional Name: 2-[4-keto-2-[[(4-methoxyphenyl)thio]methyl]-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]acetonitrile Formula: C22H17N3O2S2 MolecularWeight: 419.51928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC#N

Isomeric SMILES

COC1=CC=C(C=C1)SCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2CC#N

InChI

InChI=1S/C22H17N3O2S2/c1-27-16-7-9-17(10-8-16)28-14-19-24-21-20(22(26)25(19)12-11-23)18(13-29-21)15-5-3-2-4-6-15/h2-10,13H,12,14H2,1H3